| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 25 | Yes |
Popular Name: 1-benzyl-N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]piperidin-4-amine 1-benzyl-N-[(7-bromo-1,3-benzodi…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.94 | 10.47 | -125.09 | 3 | 4 | 2 | 40 | 405.336 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 9.2 | -42.72 | 2 | 4 | 1 | 35 | 404.328 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.94 | 8.11 | -50.28 | 2 | 4 | 1 | 38 | 404.328 | 5 | ↓ |
